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CHEBI ONTOLOGY - ANNOTATIONS

The Chemical Entities of Biological Interest (ChEBI) ontology is downloaded weekly from EMBL-EBI at http://www.ebi.ac.uk/chebi/. The data is made available under the Creative Commons License (CC BY 3.0, http://creativecommons.org/licenses/by/3.0/). For more information see: Degtyarenko et al. (2008) ChEBI: a database and ontology for chemical entities of biological interest. Nucleic Acids Res. 36, D344–D350.

Term:vatalanib
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Accession:CHEBI:90620 term browser browse the term
Definition:A member of the class of phthalazines that is phthalazine in which the hydrogens at positions 1 and 4have been replaced by a p-chlorophenylamino group and a pyridin-4-ylmethyl group, respectively. It is a multi-targeted tyrosine kinase inhibitor for all isoforms of VEGFR, PDGFR and c-Kit.
Synonyms:exact_synonym: N-(4-chlorophenyl)-4-(pyridin-4-ylmethyl)phthalazin-1-amine
 related_synonym: CGP-79787;   CGP79787;   Formula=C20H15ClN4;   InChI=1S/C20H15ClN4/c21-15-5-7-16(8-6-15)23-20-18-4-2-1-3-17(18)19(24-25-20)13-14-9-11-22-12-10-14/h1-12H,13H2,(H,23,25);   InChIKey=YCOYDOIWSSHVCK-UHFFFAOYSA-N;   N-(4-chlorophenyl)-4-(4-pyridinylmethyl)-1-phthalazinamine;   N-(p-chlorophenyl)-4-(pyridin-4-ylmethyl)phthalazin-1-amine;   PTK-787;   PTK/ZK;   PTK787;   SMILES=N1=NC(=C2C(=C1CC=3C=CN=CC3)C=CC=C2)NC4=CC=C(C=C4)Cl;   ZK-232934
 xref: CAS:212141-54-3;   DrugBank:DB04879;   KEGG:D06285;   LINCS:LSM-5774
 xref_mesh: MESH:C404768
 xref: PMID:16882767;   PMID:21617019;   PMID:22197613;   PMID:22664478;   PMID:22910317;   PMID:23488610;   PMID:23700288;   PMID:24449400;   PMID:24799063;   PMID:24838014;   PMID:24939212;   PMID:25340839;   PMID:26206183;   PMID:26403354;   Reaxys:8638800;   Wikipedia:Vatalanib


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vatalanib term browser
Symbol Object Name Qualifiers Evidence Notes Source PubMed Reference(s) RGD Reference(s) Position
G Cyp2b3 cytochrome P450, family 2, subfamily b, polypeptide 3 multiple interactions ISO [vatalanib co-treated with NR1I3 protein alternative form] results in increased expression of CYP2B6 mRNA CTD PMID:31312845 NCBI chr 1:83,163,103...83,236,615
Ensembl chr 1:83,163,079...83,236,615
JBrowse link
G Nr1i3 nuclear receptor subfamily 1, group I, member 3 multiple interactions ISO [vatalanib co-treated with NR1I3 protein alternative form] results in increased expression of CYP2B6 mRNA; vatalanib inhibits the reaction [ethyl (5-(diethylglycyl)-10,11-dihydro-5H-dibenzo(b,f)azepin-3-yl)carbamate results in decreased activity of NR1I3 protein] CTD PMID:31312845 NCBI chr13:89,585,072...89,591,278
Ensembl chr13:89,586,283...89,591,277
JBrowse link

Term paths to the root
Path 1
Term Annotations click to browse term
  CHEBI ontology 19770
    role 19720
      application 19411
        pharmaceutical 19299
          drug 19299
            antineoplastic agent 17257
              vatalanib 2
                vatalanib succinate 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 19770
    subatomic particle 19768
      composite particle 19768
        hadron 19768
          baryon 19768
            nucleon 19768
              atomic nucleus 19768
                atom 19768
                  main group element atom 19662
                    main group molecular entity 19662
                      s-block molecular entity 19429
                        hydrogen molecular entity 19423
                          hydrides 18758
                            inorganic hydride 17453
                              pnictogen hydride 17428
                                nitrogen hydride 17272
                                  azane 17003
                                    ammonia 17002
                                      organic amino compound 17001
                                        secondary amino compound 6547
                                          vatalanib 2
                                            vatalanib succinate 0
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